LBF09000OX01
From Metabolomics.JP
Upper classes
IDs and Links | |
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LipidBank | DFA0406 |
LipidMaps | LMFA01060022 |
CAS | |
KEGG | {{{KEGG}}} |
KNApSAcK | |
CDX file | |
MOL file | LBF09000OX01.mol |
n-Heptanoylacetic acid | |
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Structural Information | |
Systematic Name | 2-Oxononanoic acid |
Common Name |
|
Symbol | |
Formula | C9H16O3 |
Exact Mass | 172.109944378 |
Average Mass | 172.22154 |
SMILES | CCCCCCCC(=O)C(O)=O |
Physicochemical Information | |
Melting Point | 43-44 °C ( With decomposition ) / 98-98.5 °C [ oxime ] |
Boiling Point | |
Density | |
Optical Rotation | |
Reflactive Index | |
Solubility | <<0008>><<0009>> |
Spectral Information | |
Mass Spectra | |
UV Spectra | |
IR Spectra | |
NMR Spectra | |
Chromatograms |